UCSF

ZINC42027571

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2010 17 Yes

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.27 2.32 -6.61 1 4 0 42 240.347 5
Mid Mid (pH 6-8) 1.27 5.37 -40.71 2 4 1 43 241.355 5

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.